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1780970-70-8

1780970-70-8 | 1,3-Azetidinedicarboxylic acid, 3-methoxy-, 1-(1,1-dimethylethyl) ester

CAS No: 1780970-70-8 Catalog No: AG0025QT MDL No:MFCD30749381

Product Description

Catalog Number:
AG0025QT
Chemical Name:
1,3-Azetidinedicarboxylic acid, 3-methoxy-, 1-(1,1-dimethylethyl) ester
CAS Number:
1780970-70-8
Molecular Formula:
C10H16NO5-
Molecular Weight:
230.2377
MDL Number:
MFCD30749381
IUPAC Name:
3-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-3-carboxylic acid
InChI:
InChI=1S/C10H17NO5/c1-9(2,3)16-8(14)11-5-10(6-11,15-4)7(12)13/h5-6H2,1-4H3,(H,12,13)
InChI Key:
RDCWOPRWTAQCRG-UHFFFAOYSA-N
SMILES:
COC1(CN(C1)C(=O)OC(C)(C)C)C(=O)[O-]

Properties

Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.111g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.248g/mol
Monoisotopic Mass:
231.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  

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